10-hexyl-3-(10-hexylphenothiazin-3-yl)-7-phenyl-phenothiazine

Systemtic Name: 10-hexyl-3-(10-hexylphenothiazin-3-yl)-7-phenyl-phenothiazine Openeye Name: 10-hexyl-3-(10-hexylphenothiazin-3-yl)-7-phenyl-phenothiazine CAS Name: 10-hexyl-3-(10-hexyl-3-phenothiazinyl)-7-phenylphenothiazine IUPAC Name: 10-hexyl-3-(10-hexylphenothiazin-3-yl)-7-phenylphenothiazine Traditional Name: 10-hexyl-3-(10-hexylphenothiazin-3-yl)-7-phenyl-phenothiazine Formula: C42H44N2S2 MolecularWeight: 640.94216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=C(C=C2)C3=CC=CC=C3)SC4=C1C=CC(=C4)C5=CC6=C(C=C5)N(C7=CC=CC=C7S6)CCCCCC

Isomeric SMILES

CCCCCCN1C2=C(C=C(C=C2)C3=CC=CC=C3)SC4=C1C=CC(=C4)C5=CC6=C(C=C5)N(C7=CC=CC=C7S6)CCCCCC

InChI

InChI=1S/C42H44N2S2/c1-3-5-7-14-26-43-35-18-12-13-19-39(35)45-40-29-33(21-24-36(40)43)34-22-25-38-42(30-34)46-41-28-32(31-16-10-9-11-17-31)20-23-37(41)44(38)27-15-8-6-4-2/h9-13,16-25,28-30H,3-8,14-15,26-27H2,1-2H3